@MOLECULE 1-(2-deoxy-5-o-phosphonatopentofuranosyl)-5-fluoro-2,4(1h,3h)-pyrimidinedione 33 34 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 P -4.2717 -0.9832 -0.1474 P.3 1 UNL1 0.3522 2 F 2.9489 -2.8776 0.7898 F 1 UNL1 -0.0991 3 O -0.1001 0.6106 -0.6574 O.3 1 UNL1 -0.4116 4 O -1.3363 3.0784 1.0068 O.3 1 UNL1 -0.5551 5 O -2.8614 -0.4213 0.3202 O.3 1 UNL1 -0.2872 6 O 3.6297 2.0514 -1.1149 O.2 1 UNL1 -0.5109 7 O -4.3042 -0.8169 -1.7413 O.3 1 UNL1 -0.4383 8 O -5.3694 0.0918 0.2667 O.3 1 UNL1 -0.3040 9 O -4.4473 -2.2978 0.4367 O.2 1 UNL1 -0.1977 10 O 5.4812 -1.8626 0.2689 O.2 1 UNL1 -0.4246 11 N 2.2076 0.4370 -0.3511 N.ar 1 UNL1 -0.5029 12 N 4.5784 0.0866 -0.4328 N.ar 1 UNL1 -0.6207 13 C -0.4023 2.0480 1.2392 C.3 1 UNL1 0.1171 14 C -0.9230 0.7907 0.5058 C.3 1 UNL1 0.0638 15 C 0.9335 2.3861 0.5595 C.3 1 UNL1 -0.4027 16 C 1.0664 1.3738 -0.5917 C.3 1 UNL1 0.3345 17 C -2.3647 0.8940 -0.0097 C.3 1 UNL1 -0.0354 18 C 3.4937 0.9303 -0.6712 C.ar 1 UNL1 0.6975 19 C 2.0149 -0.8504 0.1137 C.ar 1 UNL1 0.1044 20 C 3.0951 -1.6458 0.3341 C.ar 1 UNL1 -0.1285 21 C 4.4713 -1.2335 0.0873 C.ar 1 UNL1 0.5816 22 H -0.3120 1.8877 2.3329 H 1 UNL1 0.1300 23 H -0.7857 -0.1284 1.1254 H 1 UNL1 0.1595 24 H 0.9250 3.4204 0.1630 H 1 UNL1 0.1846 25 H 1.7851 2.3458 1.2588 H 1 UNL1 0.1760 26 H 1.1954 1.8298 -1.6071 H 1 UNL1 0.1743 27 H -2.3725 1.1131 -1.0971 H 1 UNL1 0.1531 28 H -2.9431 1.6724 0.5310 H 1 UNL1 0.1591 29 H -1.1361 3.8641 1.5513 H 1 UNL1 0.3238 30 H 0.9762 -1.1817 0.2778 H 1 UNL1 0.2082 31 H 5.5105 0.4470 -0.6578 H 1 UNL1 0.3500 32 H -3.7451 -1.5450 -2.1793 H 1 UNL1 0.3343 33 H -5.6318 0.6421 -0.5605 H 1 UNL1 0.3145 @BOND 1 32 7 1 2 7 1 1 3 26 16 1 4 6 18 2 5 27 17 1 6 18 12 ar 7 18 11 ar 8 31 12 1 9 3 16 1 10 3 14 1 11 16 11 1 12 16 15 1 13 33 8 1 14 12 21 ar 15 11 19 ar 16 1 8 1 17 1 5 1 18 1 9 2 19 17 5 1 20 17 14 1 21 17 28 1 22 21 10 2 23 21 20 ar 24 19 30 1 25 19 20 ar 26 24 15 1 27 20 2 1 28 14 23 1 29 14 13 1 30 15 13 1 31 15 25 1 32 4 13 1 33 4 29 1 34 13 22 1